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- W2010044418 abstract "High level quantum chemical calculations on the open shell SH x H(2)O complex have been carried out using coupled-cluster theory. Two stable isomers of the complex are found. The equilibrium geometries, binding energies, and spectroscopic properties for both isomers of the SH x H(2)O open shell complex are presented. The bonding feature of the complexes is compared with another important open shell complex OH x H(2)O using the natural bond orbital theory." @default.
- W2010044418 created "2016-06-24" @default.
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- W2010044418 date "2009-03-23" @default.
- W2010044418 modified "2023-09-24" @default.
- W2010044418 title "Spectroscopic properties and stability of the SH⋅H2O open shell complex" @default.
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- W2010044418 doi "https://doi.org/10.1063/1.3089869" @default.
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